ChemSpider 2D Image | 3-Ethoxy-3-oxopropyl 2,3-difluorobenzoate | C12H12F2O4

3-Ethoxy-3-oxopropyl 2,3-difluorobenzoate

  • Molecular FormulaC12H12F2O4
  • Average mass258.218 Da
  • Monoisotopic mass258.070374 Da
  • ChemSpider ID30478274

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2,3-Difluorobenzoate de 3-éthoxy-3-oxopropyle [French] [ACD/IUPAC Name]
3-Ethoxy-3-oxopropyl 2,3-difluorobenzoate [ACD/IUPAC Name]
3-Ethoxy-3-oxopropyl-2,3-difluorbenzoat [German] [ACD/IUPAC Name]
Benzoic acid, 2,3-difluoro-, 3-ethoxy-3-oxopropyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 335.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.8±3.0 kJ/mol
Flash Point: 151.2±22.8 °C
Index of Refraction: 1.480
Molar Refractivity: 58.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 54.75
ACD/KOC (pH 5.5): 610.84
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 54.75
ACD/KOC (pH 7.4): 610.84
Polar Surface Area: 53 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 205.3±3.0 cm3

Click to predict properties on the Chemicalize site


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